SCHEMBL4243191

SCHEMBL4243191

O=C(Nc1ccc(C2CCCCC2)cc1)C1=C(O)CC(c2ccccc2)NC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 1/20 0.50
HDAC3 O15379 2/20 0.47
HDAC11 Q96DB2 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
LDHA P00338 3/20 0.45
MITF O75030 1/20 0.42
KLF5 Q13887 1/20 0.42
JAK3 P52333 1/20 0.41
NAMPT P43490 1/20 0.41
NR3C1 P04150 2/20 0.40
DGAT1 O75907 1/20 0.40
LDHB P07195 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
RAB9A P51151 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4237487 1.00 DEGS1 (0.50) DEGS1HDAC3HDAC11HDAC8HDAC6
SCHEMBL4241902 1.00 DEGS1 (0.50) DEGS1HDAC3HDAC11HDAC8HDAC6
SCHEMBL13743306 0.86 LDHA (0.43) LDHANAMPTLDHBALDH1A1
SCHEMBL4380936 0.85 LDHA (0.49) DEGS1LDHALDHBALDH1A1HPGD
SCHEMBL4248057 0.85 LDHA (0.49) DEGS1LDHALDHBALDH1A1HPGD
SCHEMBL4384687 0.85 LDHA (0.49) DEGS1LDHALDHBALDH1A1HPGD
SCHEMBL4245974 0.84 DEGS1 (0.46) DEGS1HDAC3HDAC11HDAC8HDAC6
SCHEMBL13743432 0.84 DEGS1 (0.52) DEGS1HDAC3HDAC11HDAC8HDAC6
SCHEMBL4242831 0.84 LDHA (0.48) DEGS1LDHALDHBALDH1A1HPGD
SCHEMBL4566900 0.84 LDHA (0.48) LDHAMITFLDHBALDH1A1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE HURLEY TIMOTHY BRIAN 2009-08-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090203694-A1 INHIBITORS OF UNDECAPRENYL PYROPHOSPHATE SYNTHASE FDPS, UMPS, GGPS1 DEGS1 496/4885HDAC3 3582/4885HDAC11 3050/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.